Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qu9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NE GLU 107.A OE1 no hydrogen 3.214 N/A ARG 4.A NH1 TRP 221.A O no hydrogen 3.139 N/A ARG 4.A NH1 ILE 224.A O no hydrogen 2.528 N/A ARG 4.A NH2 GLU 107.A OE1 no hydrogen 3.229 N/A ARG 4.A NH2 GLU 107.A OE2 no hydrogen 3.047 N/A ARG 4.A NH2 TRP 221.A O no hydrogen 3.273 N/A LYS 6.A NZ ASP 167.A OD2 no hydrogen 3.189 N/A LEU 7.A N ARG 4.A O no hydrogen 3.235 N/A LYS 8.A N GLU 168.A O no hydrogen 2.649 N/A ALA 9.A N GLU 168.A O no hydrogen 3.149 N/A VAL 10.A N THR 110.A O no hydrogen 2.826 N/A LEU 11.A N VAL 170.A O no hydrogen 2.756 N/A PHE 12.A N MET 112.A O no hydrogen 2.829 N/A ASP 13.A N ILE 172.A O no hydrogen 3.115 N/A GLY 16.A N PHE 19.A O no hydrogen 2.804 N/A VAL 17.A N MET 14.A O no hydrogen 3.149 N/A LEU 18.A N MET 14.A O no hydrogen 2.817 N/A PHE 19.A N MET 14.A O no hydrogen 3.169 N/A ASN 20.A N GLU 92.A O no hydrogen 2.803 N/A SER 21.A OG ASN 15.A OD1 no hydrogen 2.529 N/A SER 21.A OG PHE 19.A O no hydrogen 3.532 N/A TYR 24.A OH PRO 89.A O no hydrogen 2.571 N/A HIS 25.A N SER 21.A O no hydrogen 2.997 N/A SER 26.A N MET 22.A O no hydrogen 2.808 N/A SER 26.A OG MET 22.A O no hydrogen 2.572 N/A SER 26.A OG PRO 23.A O no hydrogen 2.990 N/A GLU 27.A N PRO 23.A O no hydrogen 3.179 N/A ALA 28.A N TYR 24.A O no hydrogen 2.934 N/A TRP 29.A N HIS 25.A O no hydrogen 3.002 N/A HIS 30.A N SER 26.A O no hydrogen 3.080 N/A HIS 30.A ND1 LEU 40.A O no hydrogen 2.957 N/A GLN 31.A N GLU 27.A O no hydrogen 2.911 N/A GLN 31.A NE2 GLU 27.A OE2 no hydrogen 2.957 N/A VAL 32.A N ALA 28.A O no hydrogen 2.991 N/A MET 33.A N TRP 29.A O no hydrogen 2.965 N/A LYS 34.A N HIS 30.A O no hydrogen 2.971 N/A LYS 34.A NZ HIS 30.A NE2 no hydrogen 3.216 N/A THR 35.A N GLN 31.A O no hydrogen 2.944 N/A THR 35.A OG1 GLN 31.A O no hydrogen 3.108 N/A HIS 36.A N VAL 32.A O no hydrogen 3.046 N/A GLY 37.A N LYS 34.A O no hydrogen 3.024 N/A LEU 38.A N MET 33.A O no hydrogen 2.804 N/A ARG 42.A NE GLU 27.A OE1 no hydrogen 2.671 N/A ARG 42.A NH2 GLU 27.A OE1 no hydrogen 3.463 N/A ARG 42.A NH2 GLU 27.A OE2 no hydrogen 3.195 N/A GLU 44.A N SER 41.A OG no hydrogen 3.093 N/A ALA 45.A N SER 41.A O no hydrogen 2.997 N/A TYR 46.A N ARG 42.A O no hydrogen 3.120 N/A MET 47.A N GLU 43.A O no hydrogen 3.139 N/A HIS 48.A N GLU 44.A O no hydrogen 3.014 N/A GLU 49.A N TYR 46.A O no hydrogen 3.215 N/A ARG 51.A N HIS 48.A O no hydrogen 3.110 N/A ARG 51.A NE HIS 48.A ND1 no hydrogen 3.051 N/A SER 55.A N THR 52.A OG1 no hydrogen 2.780 N/A THR 56.A N THR 52.A O no hydrogen 2.833 N/A THR 56.A OG1 THR 52.A O no hydrogen 2.922 N/A ILE 57.A N GLY 53.A O no hydrogen 2.879 N/A ASN 58.A N ALA 54.A O no hydrogen 3.059 N/A ILE 59.A N SER 55.A O no hydrogen 2.907 N/A VAL 60.A N THR 56.A O no hydrogen 3.010 N/A PHE 61.A N ILE 57.A O no hydrogen 2.915 N/A GLN 62.A N ASN 58.A O no hydrogen 2.985 N/A GLN 62.A NE2.B GLU 68.A OE2 no hydrogen 3.551 N/A ARG 63.A N ILE 59.A O no hydrogen 2.973 N/A ARG 63.A NH1 GLU 44.A OE1 no hydrogen 2.994 N/A GLU 64.A N VAL 60.A O no hydrogen 3.011 N/A LEU 65.A N PHE 61.A O no hydrogen 2.859 N/A GLY 66.A N GLN 62.A O no hydrogen 2.898 N/A THR 70.A N GLU 73.A OE1 no hydrogen 2.982 N/A THR 70.A OG1 GLU 72.A OE2 no hydrogen 3.301 N/A GLN 71.A NE2 GLU 75.A OE1.A no hydrogen 3.260 N/A GLU 73.A N THR 70.A OG1 no hydrogen 3.100 N/A ILE 74.A N THR 70.A O no hydrogen 2.924 N/A GLU 75.A N GLN 71.A O no hydrogen 2.907 N/A SER 76.A N GLU 72.A O no hydrogen 2.939 N/A SER 76.A OG.A GLU 72.A O no hydrogen 2.666 N/A SER 76.A OG.B GLU 72.A O no hydrogen 3.474 N/A SER 76.A OG.B GLU 73.A O no hydrogen 3.122 N/A ILE 77.A N GLU 73.A O no hydrogen 2.902 N/A TYR 78.A N ILE 74.A O no hydrogen 2.978 N/A HIS 79.A N GLU 75.A O no hydrogen 2.976 N/A GLU 80.A N SER 76.A O no hydrogen 2.954 N/A LYS 81.A N ILE 77.A O no hydrogen 2.814 N/A LYS 81.A NZ HIS 25.A ND1 no hydrogen 2.929 N/A LYS 81.A NZ GLN 119.A OE1 no hydrogen 3.546 N/A SER 82.A N TYR 78.A O no hydrogen 3.069 N/A ILE 83.A N HIS 79.A O no hydrogen 3.010 N/A LEU 84.A N GLU 80.A O no hydrogen 2.915 N/A PHE 85.A N LYS 81.A O no hydrogen 2.851 N/A ASN 86.A N SER 82.A O no hydrogen 2.877 N/A SER 87.A N LEU 84.A O no hydrogen 3.177 N/A SER 87.A OG LEU 84.A O no hydrogen 2.777 N/A TYR 88.A N PHE 85.A O no hydrogen 3.446 N/A ARG 93.A NH1 ASN 129.A OD1 no hydrogen 2.880 N/A MET 94.A N LEU 18.A O no hydrogen 2.840 N/A ALA 97.A N MET 94.A O no hydrogen 3.077 N/A LEU 100.A N GLY 96.A O no hydrogen 2.873 N/A LEU 101.A N ALA 97.A O no hydrogen 2.974 N/A GLN 102.A N TRP 98.A O no hydrogen 3.085 N/A LYS 103.A N GLU 99.A O no hydrogen 3.143 N/A LYS 103.A NZ CYS 218.A O no hydrogen 2.634 N/A VAL 104.A N LEU 100.A O no hydrogen 2.871 N/A LYS 105.A N LEU 101.A O no hydrogen 3.014 N/A LYS 105.A NZ GLY 132.A O no hydrogen 3.134 N/A LYS 105.A NZ MET 133.A O no hydrogen 3.375 N/A SER 106.A N GLN 102.A O no hydrogen 2.994 N/A SER 106.A OG.A GLN 102.A O no hydrogen 3.301 N/A SER 106.A OG.B GLN 102.A O no hydrogen 3.172 N/A SER 106.A OG.B LYS 103.A O no hydrogen 2.711 N/A GLU 107.A N LYS 103.A O no hydrogen 3.101 N/A GLU 107.A N VAL 104.A O no hydrogen 3.258 N/A GLY 108.A N LYS 105.A O no hydrogen 3.034 N/A LEU 109.A N VAL 104.A O no hydrogen 3.112 N/A THR 110.A N LYS 8.A O no hydrogen 2.979 N/A MET 112.A N VAL 10.A O no hydrogen 2.824 N/A VAL 113.A N LEU 138.A O no hydrogen 3.398 N/A VAL 114.A N PHE 12.A O no hydrogen 2.737 N/A THR 115.A N VAL 140.A O no hydrogen 2.726 N/A SER 117.A N THR 115.A OG1 no hydrogen 2.888 N/A GLN 119.A N SER 117.A OG no hydrogen 3.020 N/A GLN 119.A NE2 SER 82.A O no hydrogen 3.526 N/A GLN 119.A NE2 SER 82.A OG no hydrogen 2.933 N/A SER 121.A OG ASN 86.A OD1 no hydrogen 2.768 N/A LEU 122.A N GLN 119.A O no hydrogen 3.056 N/A LEU 123.A N GLN 119.A O no hydrogen 3.118 N/A GLU 124.A N LEU 120.A O no hydrogen 2.879 N/A ARG 125.A N LEU 122.A O no hydrogen 3.033 N/A ARG 125.A NH1.A ALA 91.A O no hydrogen 3.118 N/A ARG 125.A NH1.B ALA 91.A O no hydrogen 2.437 N/A ARG 125.A NH2.A ALA 91.A O no hydrogen 2.485 N/A ARG 125.A NH2.B ALA 91.A O no hydrogen 3.360 N/A LEU 126.A N LEU 123.A O no hydrogen 3.244 N/A ASN 129.A N ARG 125.A O no hydrogen 2.960 N/A ASN 129.A N LEU 126.A O no hydrogen 3.271 N/A ASN 129.A ND2 ARG 125.A O no hydrogen 2.809 N/A PHE 130.A N LEU 126.A O no hydrogen 2.834 N/A GLY 132.A N GLU 127.A OE2 no hydrogen 2.857 N/A MET 133.A N PHE 130.A O no hydrogen 3.280 N/A LEU 138.A N HIS 135.A O no hydrogen 2.942 N/A VAL 140.A N VAL 113.A O no hydrogen 2.604 N/A THR 141.A N ASP 144.A OD2 no hydrogen 2.978 N/A ALA 142.A N SER 117.A O no hydrogen 3.178 N/A PHE 143.A N THR 141.A OG1 no hydrogen 3.067 N/A ASP 144.A N THR 141.A O no hydrogen 3.040 N/A LYS 146.A N GLU 153.A OE2 no hydrogen 2.884 N/A TYR 147.A N GLU 153.A OE1 no hydrogen 2.922 N/A GLY 148.A N GLU 153.A OE1 no hydrogen 2.697 N/A LYS 149.A NZ VAL 114.A O no hydrogen 3.126 N/A LYS 149.A NZ GLU 173.A OE2 no hydrogen 2.745 N/A ASN 151.A N GLY 148.A O no hydrogen 3.019 N/A TYR 155.A N PRO 152.A O no hydrogen 3.109 N/A TYR 155.A OH GLU 173.A OE2 no hydrogen 2.547 N/A LEU 156.A N PRO 152.A O no hydrogen 3.018 N/A MET 157.A N GLU 153.A O no hydrogen 2.896 N/A ALA 158.A N PRO 154.A O no hydrogen 2.985 N/A LEU 159.A N TYR 155.A O no hydrogen 2.887 N/A LYS 160.A N LEU 156.A O no hydrogen 3.110 N/A LYS 161.A N MET 157.A O no hydrogen 2.901 N/A GLY 162.A N ALA 158.A O no hydrogen 2.917 N/A GLY 163.A N LYS 160.A O no hydrogen 3.042 N/A LEU 164.A N LEU 159.A O no hydrogen 2.752 N/A LYS 165.A N GLU 168.A OE1 no hydrogen 3.019 N/A GLU 168.A N LYS 165.A O no hydrogen 2.782 N/A VAL 170.A N ALA 9.A O no hydrogen 3.070 N/A VAL 171.A N PHE 188.A O no hydrogen 2.851 N/A ILE 172.A N LEU 11.A O no hydrogen 2.857 N/A GLU 173.A N ILE 190.A O no hydrogen 2.982 N/A ASN 174.A N GLU 173.A OE1 no hydrogen 3.260 N/A ASN 174.A ND2 GLU 49.A OE1 no hydrogen 3.437 N/A ASN 174.A ND2 GLU 49.A OE2 no hydrogen 2.884 N/A VAL 179.A N ALA 175.A O no hydrogen 2.872 N/A GLU 180.A N PRO 176.A O no hydrogen 2.878 N/A ALA 181.A N LEU 177.A O no hydrogen 3.029 N/A GLY 182.A N GLY 178.A O no hydrogen 3.083 N/A HIS 183.A N VAL 179.A O no hydrogen 2.950 N/A LYS 184.A N GLU 180.A O no hydrogen 2.895 N/A LYS 184.A NZ GLU 180.A OE2 no hydrogen 3.054 N/A ALA 185.A N ALA 181.A O no hydrogen 3.176 N/A ALA 185.A N GLY 182.A O no hydrogen 3.140 N/A GLY 186.A N HIS 183.A O no hydrogen 2.756 N/A ILE 187.A N GLY 182.A O no hydrogen 3.215 N/A THR 189.A N ASP 208.A OD2 no hydrogen 2.856 N/A THR 189.A OG1.A ILE 187.A O no hydrogen 3.092 N/A THR 189.A OG1.B ASP 208.A OD2 no hydrogen 3.382 N/A ILE 190.A N VAL 171.A O no hydrogen 2.740 N/A ALA 191.A N LEU 209.A O no hydrogen 2.867 N/A VAL 192.A N GLU 173.A O no hydrogen 2.824 N/A ASN 193.A N PHE 211.A O no hydrogen 2.812 N/A ASN 193.A ND2 LEU 197.A O no hydrogen 2.836 N/A THR 194.A OG1 GLY 16.A O no hydrogen 2.714 N/A GLN 200.A NE2 ASP 204.A OD1 no hydrogen 2.733 N/A VAL 201.A N ASP 198.A O no hydrogen 3.075 N/A LEU 202.A N GLY 199.A O no hydrogen 3.077 N/A LEU 203.A N GLY 199.A O no hydrogen 3.252 N/A ASP 204.A N GLN 200.A O no hydrogen 2.817 N/A ALA 205.A N LEU 202.A O no hydrogen 3.358 N/A GLY 206.A N LEU 203.A O no hydrogen 2.996 N/A ALA 207.A N LEU 202.A O no hydrogen 3.255 N/A ASP 208.A N THR 189.A O no hydrogen 2.780 N/A LEU 209.A N THR 189.A O no hydrogen 3.475 N/A PHE 211.A N ALA 191.A O no hydrogen 2.758 N/A SER 213.A N THR 216.A OG1 no hydrogen 3.278 N/A SER 213.A OG THR 216.A OG1 no hydrogen 2.993 N/A GLN 215.A NE2 GLU 99.A OE1 no hydrogen 2.960 N/A GLN 215.A NE2 GLN 215.A O no hydrogen 3.225 N/A GLN 215.A NE2 ASP 219.A OD1 no hydrogen 3.252 N/A THR 216.A N SER 213.A OG no hydrogen 3.024 N/A THR 216.A OG1 SER 213.A O no hydrogen 3.042 N/A THR 216.A OG1 SER 213.A OG no hydrogen 2.993 N/A LEU 217.A N SER 213.A O no hydrogen 3.216 N/A CYS 218.A N MET 214.A O no hydrogen 2.925 N/A ASP 219.A N GLN 215.A O no hydrogen 2.902 N/A SER 220.A N THR 216.A O no hydrogen 2.996 N/A SER 220.A OG THR 216.A O no hydrogen 3.108 N/A TRP 221.A N CYS 218.A O no hydrogen 3.433 N/A TRP 221.A NE1 GLU 107.A OE2 no hydrogen 2.988 N/A THR 223.A N SER 220.A O no hydrogen 3.198 N/A THR 223.A OG1 SER 220.A O no hydrogen 3.410 N/A THR 223.A OG1 THR 223.A O no hydrogen 2.298 N/A